Journal of Chemical Physics

Journal of Chemical Physics, Vol.119, No.19 Entire volume, number list

ISSN: 0021-9606 (Print)

In this Issue (59 articles)

9981 - 9984	Spectroscopic characterization of HOONO and its binding energy via infrared action spectroscopy Pollack IB, Konen IM, Li EXJ, Lester MI
9985 - 9988	Dynamics of the gas-liquid interfacial reaction of O(P-3) atoms with hydrocarbons Kelso H, Kohler SPK, Henderson DA, McKendrick KG
9989 - 9992	State-to-state photodissociation dynamics of OH radical via the A(2)Sigma(+) state: Fine-structure distributions of the O(P-3(J)) product Zhou WD, Yuan Y, Zhang JS
9993 - 10001	Robust control of quantum information Pravia MA, Boulant N, Emerson J, Farid A, Fortunato EM, Havel TF, Martinez R, Cory DG
10002 - 10014	Interpolating moving least-squares methods for fitting potential energy surfaces: Detailed analysis of one-dimensional applications Maisuradze GG, Thompson DL, Wagner AF, Minkoff M
10015 - 10031	Transcorrelated method for electronic systems coupled with variational Monte Carlo calculation Umezawa N, Tsuneyuki S
10032 - 10039	Time-resolved study of the symmetric S(N)2-reaction I-+CH3I Wester R, Bragg AE, Davis AV, Neumark DM
10040 - 10047	Influence of collision energy on the N(D-2)+O-2 -> O(P-3)+NO reaction dynamics: A quasiclassical trajectory study involving four potential energy surfaces Miquel I, Hernando J, Sayos R, Gonzalez M
10048 - 10062	Zero temperature quantum properties of small protonated water clusters (H2O)(n)H+ (n=1-5) Mella M, Clary DC
10063 - 10068	An ab initio investigation on the vertical electron detachment energies of semiconductor-alkali binary anions E(n)A(-) (A = K, Na, Li; E = Ge, Si; n = 1-10) Li SD, Ren GM, Jin ZH
10069 - 10072	Experimental evidence for the 7,7,8,8-tetracyano-p-quinodimethane dianion in vacuo Nielsen SB, Nielsen MB
10073 - 10080	Ab initio quantum chemical calculations for fullerene cages with large holes Hu YH, Ruckenstein E
10081 - 10087	Ab initio calculation of interaction nature of borazine (B3N3H6) dimer Kawahara S, Tsuzuki S, Uchimaru T
10088 - 10104	Transition state spectroscopy of the excited electronic states of Li-HF Aguado A, Paniagua M, Sanz C, Roncero O
10105 - 10114	Structural and thermochemical properties of the hydroxymethyl (CH2OH) radical: A high precision ab initio study Marenich AV, Boggs JE
10115 - 10124	The Renner-Teller effect and Sears resonances in the ground state of the GeCH and GeCD free radicals He SG, Li HY, Smith TC, Clouthier DJ, Merer AJ
10125 - 10132	Fragmentation mechanisms of aqueous clusters charged with ions Consta S, Mainer KR, Novak W
10133 - 10137	Improving ab initio infrared spectra of glucose-water complexes by considering explicit intermolecular hydrogen bonds Suzuki T, Sota T
10138 - 10145	Large anharmonic effects in the infrared spectra of the symmetrical CH3NO2-center dot(H2O) and CH3CO2-center dot(H2O) complexes Myshakin EM, Jordan KD, Sibert EL, Johnson MA
10146 - 10157	Mode-dependent vibrational autoionization of NO2 Bell P, Aguirre F, Grant ER, Pratt ST
10158 - 10168	Vibrationally mediated dissociation dynamics of H2O in the v(OH)=2 polyad Nizkorodov SA, Ziemkiewicz M, Myers TL, Nesbitt DJ
10169 - 10174	Spectroscopic characterization of the first singlet ((A)over-tilde B-1(1)) excited state of (LiOLi)-Li-7-O-16-Li-7 Bellert D, Winn DK, Breckenridge WH
10175 - 10185	A state-selected study of the H-2(+) (X,v(+)=0-17,N+=1)+Ne proton transfer reaction using the pulsed-field ionization-photoelectron-secondary ion coincidence scheme Zhang T, Qian XM, Tang XN, Ng CY, Chiu Y, Levandier DJ, Miller JS, Dressler RA
10186 - 10193	The effect of spin-orbit coupling in complex forming O(P-3) +O-2 collisions Tashiro M, Schinke R
10194 - 10201	The low-lying electronic states of FeO+: Rotational analysis of the resonance enhanced photodissociation spectra of the (6)Pi(7/2)<- X (6)Sigma(+) system Aguirre F, Husband J, Thompson CJ, Stringer KL, Metz RB
10202 - 10208	Effect of solvent polarity on the photophysical properties of coumarin-1 dye Barik A, Nath S, Pal H
10209 - 10223	Effects of longitudinal quadrupoles on the phase behavior of a Gay-Berne fluid Withers IM
10224 - 10236	Cavity formation in the superheated Lennard-Jones liquid and its connection to homogeneous bubble nucleation: A density-functional theory study Punnathanam S, Corti DS
10237 - 10246	Computer modeling of melting of ionized ice microcrystals Brodskaya EN, Egorov AV, Lyubartsev AP, Laaksonen A
10247 - 10255	A density functional theory investigation of 1,1-diamino-2,2-dinitroethylene dimers and crystal Ju XH, Xiao HM, Xia QY
10256 - 10267	A simulation study of the quantum hard-sphere Yukawa fluid Sese LM, Bailey LE
10268 - 10273	Generalized equation of state and exclusion factor for multicomponent systems Rusanov AI
10274 - 10279	Conformational space annealing and an off-lattice frustrated model protein Kim SY, Lee SJ, Lee J
10280 - 10288	Predictions of molecular chirality and helical twisting powers: A theoretical study Earl DJ, Wilson MR
10289 - 10297	Boundary element methods for dielectric cavity construction and integration Chen FW, Chipman DM
10298 - 10306	State-resolved dynamics of 248 nm methyl-iodide fragmentation on GaAs(110) Srivastava A, Osgood RM
10307 - 10312	Reaction of tungsten anion clusters with molecular and atomic nitrogen Kim YD, Stolcic D, Fischer M, Gantefor G
10313 - 10317	Silicon and metal nanotemplates: Size and species dependence of structural and electronic properties Gueorguiev GK, Pacheco JM
10318 - 10324	Multiconfigurational self-consistent field study of the silicon carbide (001) surface Tamura H, Gordon MS
10325 - 10329	Nuclear spin polarization transfer across an organic-semiconductor interface Goehring L, Michal CA
10330 - 10338	Classical density functional study of multisite amphiphile mesostructures Christopher PS, Oxtoby DW
10339 - 10349	Langmuir films of normal-alkanes on the surface of liquid mercury Kraack H, Ocko BM, Pershan PS, Sloutskin E, Deutsch M
10350 - 10357	A continuum approach to electron solvation by a layer of polar adsorbates Sebastian KL, Chakraborty A, Tachiya M
10358 - 10362	Nuclear magnetic resonance study of the vapor phase contribution to diffusion in nanoporous glasses partially filled with water and cyclohexane Ardelean I, Mattea C, Farrher G, Wonorahardjo S, Kimmich R
10363 - 10366	Disjoining pressure of thin films on spherical core particles Napari I, Laaksonen A
10367 - 10375	Complete analysis of the angular momentum distribution of molecules desorbing from a surface Borowski S, Kluner T, Freund HJ
10376 - 10382	Phase field theory of crystal nucleation in hard sphere liquid Granasy L, Pusztai T, Toth G, Jurek Z, Conti M, Kvamme B
10383 - 10388	Osmotic de-swelling of ionic microgel particles Fernandez-Nieves A, Fernandez-Barbero A, Vincent B, de las Nieves FJ
10389 - 10395	Dissociative adsorption of pyrrole on Si(111)-(7x7) Yuan ZL, Chen XF, Wang ZH, Yong KS, Cao Y, Xu GQ
10396 - 10403	Low energy electron interaction with free and bound SF5CF3: Negative ion formation from single molecules, clusters and nanofilms Balog R, Stano M, Limao-Vieira P, Konig C, Bald I, Mason NJ, Illenberger E
10404 - 10414	A model for persistent hole burned spectra and hole growth kinetics that includes photoproduct absorption: Application to free base phthalocyanine in hyperquenched glassy ortho-dichlorobenzene at 5 K Reinot T, Dang NC, Small GJ
10415 - 10420	A joint theoretical and experimental study on the electronic properties of phenyl-capped 3,4-ethylenedioxythiophene oligomers Osikowicz W, van der Gon AWD, Crispin X, de Jong MP, Friedlein R, Groenendaal L, Fahlman M, Beljonne D, Lazzaroni R, Salaneck WR
10421 - 10427	Dynamical signature of two "ideal glass transitions" in nematic liquid crystals Cang H, Li J, Novikov VN, Fayer MD
10428 - 10437	Conformational behavior of a single polymer chain confined by a two-dimensional harmonic potential in good solvents Shew CY
10438 - 10447	Matrix-induced nanoparticle interactions in a polymer melt: A molecular dynamics simulation study Bedrov D, Smith GD, Smith JS
10448 - 10449	Comment on "A simple molecular thermodynamic theory of hydrophobic hydration" Graziano G
10450 - 10451	Response to "Comment on'A simple molecular thermodynamic theory of hydrophobic hydration' Ashbaugh HS, Truskett TM, Debenedetti PG
10452 - 10453	Semiclassical calculation of collisional dissociation cross sections for N+N-2 (vol 117, pg 6556, 2002) Tully C, Johnson RE
10454 - 10454	Electrostatic interactions in dissipative particle dynamics - simulation of polyelectrolytes and anionic surfactants (vol 118, pg 11265, 2003) Groot RD